N-(4-cyclopentylsulfanylphenyl)-3-methyl-2-nitro-benzamide

Systemtic Name: N-(4-cyclopentylsulfanylphenyl)-3-methyl-2-nitro-benzamide Openeye Name: N-(4-cyclopentylsulfanylphenyl)-3-methyl-2-nitro-benzamide CAS Name: N-[4-(cyclopentylthio)phenyl]-3-methyl-2-nitrobenzamide IUPAC Name: N-(4-cyclopentylsulfanylphenyl)-3-methyl-2-nitrobenzamide Traditional Name: N-[4-(cyclopentylthio)phenyl]-3-methyl-2-nitro-benzamide Formula: C19H20N2O3S MolecularWeight: 356.4387

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)SC3CCCC3

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NC2=CC=C(C=C2)SC3CCCC3

InChI

InChI=1S/C19H20N2O3S/c1-13-5-4-8-17(18(13)21(23)24)19(22)20-14-9-11-16(12-10-14)25-15-6-2-3-7-15/h4-5,8-12,15H,2-3,6-7H2,1H3,(H,20,22)